Dimethylformamide → N-(2-{2-[(4-{1-(4-Fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxoazetidin-2-yl}benzylcarbamoyl)methoxy]ethoxy}ethyl)-2,3,4,5,6-pentahydroxyhexanamide

HRID 1201401Notes

Reaction equation

HRID 1201401 reaction equation
[CH3:74][N:75]([CH3:76])[CH:77]=[O:78].[CH3:79][C:80]#[N:81].[CH:55]([N:56]=[C:57]=[N:58][CH:59]([CH3:60])[CH3:61])([CH3:62])[CH3:63].[NH2:1][CH2:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH:10]([CH2:21][CH2:22][CH:23]([OH:24])[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[C:11](=[O:20])[N:12]2[c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[cH:7][cH:8]1.[OH:32][CH:33]([C:34](=[O:35])[NH:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][O:42][CH2:43][C:44](=[O:45])[OH:46])[CH:47]([CH:48]([CH:49]([CH2:50][OH:51])[OH:52])[OH:53])[OH:54].[OH:64][c:65]1[c:66]2[n:67][n:68][nH:69][c:70]2[cH:71][cH:72][cH:73]1>>[NH:1]([CH2:2][c:3]1[cH:4][cH:5][c:6]([CH:9]2[CH:10]([CH2:21][CH2:22][CH:23]([OH:24])[c:25]3[cH:26][cH:27][c:28]([F:31])[cH:29][cH:30]3)[C:11](=[O:20])[N:12]2[c:13]2[cH:14][cH:15][c:16]([F:19])[cH:17][cH:18]2)[cH:7][cH:8]1)[C:44]([CH2:43][O:42][CH2:41][CH2:40][O:39][CH2:38][CH2:37][NH:36][C:34]([CH:33]([OH:32])[CH:47]([CH:48]([CH:49]([CH2:50][OH:51])[OH:52])[OH:53])[OH:54])=[O:35])=[O:45]

Participants

7

Reactant 6

HCID 6228DimethylformamideHCID 6342AcetonitrileHCID 12734DiisopropylcarbodiimideHCID 222520324-(4-Aminomethylphenyl)-1-(4-fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]azetidin-2-oneHCID 22252087{2-[2-(2,3,4,5,6-Pentahydroxyhexanoylamino)ethoxy]ethoxy}acetic acidHCID 178418300HCID 178418300, compound

Product 1

HCID 22252050N-(2-{2-[(4-{1-(4-Fluorophenyl)-3-[3-(4-fluorophenyl)-3-hydroxypropyl]-4-oxoazetidin-2-yl}benzylcarbamoyl)methoxy]ethoxy}ethyl)-2,3,4,5,6-pentahydroxyhexanamide

Sources & evidence

ORD record
ord-7ff36a35903b41f3be8787a25735c340
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…